N-[2-(4-methylphenyl)sulfanylpyridin-3-yl]-4-propyl-benzenesulfonamide

Systemtic Name: N-[2-(4-methylphenyl)sulfanylpyridin-3-yl]-4-propyl-benzenesulfonamide Openeye Name: 4-propyl-N-[2-(p-tolylsulfanyl)-3-pyridyl]benzenesulfonamide CAS Name: N-[2-[(4-methylphenyl)thio]-3-pyridinyl]-4-propylbenzenesulfonamide IUPAC Name: N-[2-(4-methylphenyl)sulfanylpyridin-3-yl]-4-propylbenzenesulfonamide Traditional Name: 4-propyl-N-[2-(p-tolylthio)-3-pyridyl]benzenesulfonamide Formula: C21H22N2O2S2 MolecularWeight: 398.54158

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N=CC=C2)SC3=CC=C(C=C3)C

Isomeric SMILES

CCCC1=CC=C(C=C1)S(=O)(=O)NC2=C(N=CC=C2)SC3=CC=C(C=C3)C

InChI

InChI=1S/C21H22N2O2S2/c1-3-5-17-9-13-19(14-10-17)27(24,25)23-20-6-4-15-22-21(20)26-18-11-7-16(2)8-12-18/h4,6-15,23H,3,5H2,1-2H3